3,4-Dihydroxy-5-nitrobenzophenone
TL;DR: 3,4-Dihydroxy-5-nitrobenzophenone (CAS 125628-96-8) is a chemical compound with molecular formula C13H9NO5 and molecular weight 259.04807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4-dihydroxy-5-nitrophenyl)-phenylmethanone
Also Known As: 3,4-dihydroxy-5-nitrobenzophenone, (3,4-Dihydroxy-5-nitrophenyl)phenylmethanone, Methanone, (3,4-dihydroxy-5-nitrophenyl)phenyl-, (3,4-dihydroxy-5-nitrophenyl)-phenylmethanone, 5-BENZOYL-3-NITROBENZENE-1,2-DIOL
Technical Specifications
| Molecular Formula | C13H9NO5 |
| Molecular Weight | 259.04807 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.04807 Da |
| Heavy Atoms | 19 |
| Complexity | 347.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-] |
| InChIKey | MCOIDMKILOXTJS-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dihydroxy-5-nitrobenzophenone
Property Insights of 3,4-Dihydroxy-5-nitrobenzophenone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydroxy-5-nitrobenzophenone. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydroxy-5-nitrobenzophenone. Following Lipinski's Rule of Five, 3,4-Dihydroxy-5-nitrobenzophenone has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4-Dihydroxy-5-nitrobenzophenone?
The CAS number of 3,4-Dihydroxy-5-nitrobenzophenone is 125628-96-8.
What is the molecular formula of 3,4-Dihydroxy-5-nitrobenzophenone?
The molecular formula of 3,4-Dihydroxy-5-nitrobenzophenone is C13H9NO5.
What is the molecular weight of 3,4-Dihydroxy-5-nitrobenzophenone?
The molecular weight of 3,4-Dihydroxy-5-nitrobenzophenone is 259.04807 g/mol.
Where can I buy 3,4-Dihydroxy-5-nitrobenzophenone?
You can request a quote for 3,4-Dihydroxy-5-nitrobenzophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dihydroxy-5-nitrobenzophenone?
Yes, CoreyChem provides custom synthesis services for 3,4-Dihydroxy-5-nitrobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.